• Formula : SiH8
  • Space Group : I-4m2 (119)
    Centrosymmetric : False
    Dimensionality : 1D
  • Structure parameters
    a = 4.5187
    b = 4.5187
    c = 6.3169
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 9
    Total number of electrons per primitive cell = 12
  • Band gap = 6.0135 eV
    Direct Gap = 6.275 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 169739

Band structure with spin-orbit coupling